Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.49 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.46 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.46 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | MMP12 | P39900 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 2/20 | 0.40 |
| ▸ | PPARA | Q07869 | 2/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7290869 | 0.81 | HTT (0.47) | HTTCTBP2SAE1UBA2LOXL2 | |
| SCHEMBL27945030 | 0.81 | SLC22A12 (0.57) | HTTCTBP2SAE1UBA2LOXL2 | |
| SCHEMBL28246736 | 0.80 | SLC22A12 (0.56) | HTTCTBP2SAE1UBA2LOXL2 | |
| SCHEMBL8694396 | 0.79 | BLM (0.65) | HTTCTBP2SAE1UBA2LOXL2 | |
| SCHEMBL6361552 | 0.75 | ALDH1A1 (0.47) | HTTCTBP2SAE1UBA2LOXL2 | |
| SCHEMBL6371871 | 0.74 | CYP2A6 (0.47) | HTTCTBP2SAE1UBA2LOXL2 | |
| SCHEMBL335492 | 0.74 | CTBP2 (0.62) | HTTCTBP2SAE1UBA2LOXL2 | |
| Bicarbonate SCHEMBL11748879 | 0.73 | CA2 (0.61) | HTTCTBP2CYP2A6GSK3BCA2 | |
| SCHEMBL1695664 | 0.73 | LOXL2 (0.57) | HTTCTBP2SAE1UBA2LOXL2 | |
| SCHEMBL10029148 | 0.73 | CYP2A6 (0.46) | HTTCTBP2SAE1UBA2LOXL2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5463071-A | Tetrazole derivatives; useful for inhibiting undesirable cell aggregation | DR. KARL THOMAE GMBH (DE) | 1995-10-31 | — | — | US | disclosed |